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Isobutyl 4-(2-fluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID 1JFHbFRPsTF
InChI InChI=1S/C16H19FN2O3/c1-9(2)8-22-15(20)13-10(3)18-16(21)19-14(13)11-6-4-5-7-12(11)17/h4-7,9,14H,8H2,1-3H3,(H2,18,19,21)
InChIKey WBTWEDAFVHBYRK-UHFFFAOYSA-N
Mol Weight 306.34 g/mol
Molecular Formula C16H19FN2O3
Exact Mass 306.137971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PFZ7RVY194
Name Isobutyl 4-(2-fluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
CAS Registry Number 300849-75-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19FN2O3
InChI InChI=1S/C16H19FN2O3/c1-9(2)8-22-15(20)13-10(3)18-16(21)19-14(13)11-6-4-5-7-12(11)17/h4-7,9,14H,8H2,1-3H3,(H2,18,19,21)
InChIKey WBTWEDAFVHBYRK-UHFFFAOYSA-N
Molecular Weight 306.337 g/mol
SMILES N1C(NC(C(=C1C)C(OCC(C)C)=O)c1c(cccc1)F)=O
SPLASH splash10-052f-9760000000-0a170775e2ad5b8654f4
Source of Spectrum AD-0-2532-0
Synonyms 2-Methylpropyl 4-(2-fluorophenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate 2-Methylpropyl 4-(2-fluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate 4-(2-fluorophenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isobutyl ester 4-(2-fluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-methylpropyl ester isobutyl 4-(2-fluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Pyrimidine-5-carboxylic acid, 1,2,3,4-tetrahydro-4-(2-fluorophenyl)-6-methyl-2-oxo-, 2-methylpropyl ester
Wiley ID 1426685